I'm getting lots of broken bonds when I attempt to generate random  
structures using the random.inp script attached, as indicated in the  
log file (abbreviated).  These of course persist in subsequent sa  
runs.  Pls. advise.  Thanks.  David
-------------- next part --------------
A non-text attachment was scrubbed...
Name: random.inp
Type: application/octet-stream
Size: 8105 bytes
Desc: not available
Url : 
http://dcb.cit.nih.gov/pipermail/xplor-nih/attachments/20080521/82fceabb/attachment-0001.obj
 
-------------- next part --------------
A non-text attachment was scrubbed...
Name: random_log abrev.rtf
Type: text/rtf
Size: 14375 bytes
Desc: not available
Url : 
http://dcb.cit.nih.gov/pipermail/xplor-nih/attachments/20080521/82fceabb/attachment-0001.rtf
 

Reply via email to